(1R,5R)-6,6-dimethyl-3-phenylsulfanyl-bicyclo[3.1.1]hept-2-en-4-one

Systemtic Name: (1R,5R)-6,6-dimethyl-3-phenylsulfanyl-bicyclo[3.1.1]hept-2-en-4-one Openeye Name: (1R,5R)-6,6-dimethyl-3-phenylsulfanyl-bicyclo[3.1.1]hept-2-en-4-one CAS Name: (1R,5R)-6,6-dimethyl-3-(phenylthio)-4-bicyclo[3.1.1]hept-2-enone IUPAC Name: (1R,5R)-6,6-dimethyl-3-phenylsulfanylbicyclo[3.1.1]hept-2-en-4-one Traditional Name: (1R,5R)-6,6-dimethyl-3-(phenylthio)bicyclo[3.1.1]hept-2-en-4-one Formula: C15H16OS MolecularWeight: 244.35194

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CC1C(=O)C(=C2)SC3=CC=CC=C3)C

Isomeric SMILES

CC1([C@@H]2C[C@H]1C(=O)C(=C2)SC3=CC=CC=C3)C

InChI

InChI=1S/C15H16OS/c1-15(2)10-8-12(15)14(16)13(9-10)17-11-6-4-3-5-7-11/h3-7,9-10,12H,8H2,1-2H3/t10-,12+/m1/s1